CFam Chemical Families Database
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You are searching for "CFAMM00300559" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00300559
Family CFFID3966 5-hydroxytryptamine receptor 3A Ligand 3alpha-(1'-methyl-2'-indolecarbonyloxy)-tropane Family
Superfamily CFSID2693 5-hydroxytryptamine receptor 3A Ligand 3alpha-(1'-methyl-2'-indolecarbonyloxy)-tropane Superfamily
Class CFCID1596 Class 2946
External ID 21714279 External Source PubChem
PubChem CID 21714279 Functional Category Patent Compound
Molecule Name AGN-PC-03EYGA
IUPAC Name ethyl 4-chloro-1-(5-ethoxy-5-oxopentyl)indole-2-carboxylate
Synonyms SureCN7956149;1H-Indole-1-pentanoic acid, 4-chloro-2-(ethoxycarbonyl)-, ethyl ester
InChi InChI=1S/C18H22ClNO4/c1-3-23-17(21)10-5-6-11-20-15-9-7-8-14(19)13(15)12-16(20)18(22)24-4-2/h7-9,12H,3-6,10-11H2,1-2H3
InChiKey LQYKIOPBWQVHHP-UHFFFAOYSA-N
Formula C18H22ClNO4 Molecular Weight 351.82
Cross Link
Structure

Statistics of CFAM Database

 
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
 

How to cite our database

 
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
 

Last update by

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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